ID: 119722
SMILES:O(c1c(C2C(C(C)=C)CCC(C)=C2)c(OC(=O)C)ccc1OCCC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.213
InChIKey:PGFURJYSELLINM-UHFFFAOYSA-N
ID: 119723
SMILES:C(=CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -17.92
InChIKey:GKHSBAJPXIDHJT-UHFFFAOYSA-N
ID: 119724
SMILES:C1CC=C(C)CCC2C(C)(C)CC2C2(C)Oc3c1c(OC)cc(CCCCC)c3O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.284
InChIKey:BEELYUWAQUKAKS-UHFFFAOYSA-N
ID: 119725
SMILES:C1C2C3C(C3(C)C)CCC2(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.513
InChIKey:AZIKMVNCPVVUFJ-UHFFFAOYSA-N
ID: 119726
SMILES:c1(O)ccc(CC=C(CC(OC(C)=O)C=C(C)C)C)c(Oc2cc(CCCCC)cc(O)c2CC=C(C)CCC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 602.856
CB1 binding score: -13.252
InChIKey:IDCUDGYQKXCKSG-UHFFFAOYSA-N
ID: 119727
SMILES:CC1=CCC(C(C)=C)C(=O)C2OC2(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.092
InChIKey:FBZIHNOOTJHSCI-UHFFFAOYSA-N
ID: 119728
SMILES:c1(O)cc(O)c2c(c1C(CC(C)C)=O)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.831
InChIKey:YHIVFUIEZCDTGJ-UHFFFAOYSA-N
ID: 119729
SMILES:C1C=C(C)C2(C(C)CC=C1C(C)CC(C1OC1(C)C)O)CCc1cc(O)cc(CNC)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 439.64
CB1 binding score: -15.173
InChIKey:CQBDXFJZXBGLOQ-UHFFFAOYSA-N
ID: 119730
SMILES:C12c3c(O)cc(CCCC)cc3OC(C)(C)C1CCC(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.352
InChIKey:PHHCLGWGSINBOY-UHFFFAOYSA-N
ID: 119731
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CC(=O)OC)c(O)c1OC)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -14.041
InChIKey:HAMXITWVIMMJGS-UHFFFAOYSA-N
ID: 119732
SMILES:OCc1cc(O)c(C2CC(C)=CC(c3cc(CCN(C)C)ccc3OC)C2C(C)=C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 465.634
CB1 binding score: -15.105
InChIKey:NMHGPVQKKZJKGC-UHFFFAOYSA-N
ID: 119733
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C(C(=C)C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.265
InChIKey:HZBBQDWEXFTDKO-UHFFFAOYSA-N
ID: 119734
SMILES:CC1(C)Oc2cc(CCCCC)cc(OC)c2C2C1C1C(=C)CCC3C(C(C)C)=CCC3(C)C1C(=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.755
CB1 binding score: -14.942
InChIKey:CWKAIVWMNGGREG-UHFFFAOYSA-N
ID: 119735
SMILES:CC1(O)C2C(C=C(C(=O)O)CC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -16.655
InChIKey:VEZWOPKLPHVIPE-UHFFFAOYSA-N
ID: 119736
SMILES:CC1=CC2CC(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -13.8
InChIKey:JQIPLSNBBMIFKP-UHFFFAOYSA-N
ID: 119737
SMILES:C(CCC=C(C)C)(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 119738
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 119739
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)OC)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 119740
SMILES:C(C)(C)(O)C12CC(C(=C)C)C(C)(C=C)CC1=C(c1ccccc1)Oc1cc(O)cc(C)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.588
CB1 binding score: -13.493
InChIKey:WHBNDBUIKHYKAK-UHFFFAOYSA-N
ID: 119741
SMILES:c1(O)c2c(cc(CCCCC)c1)-c1c(cc(C)cc1O)C(C(C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 338.491
CB1 binding score: -15.83
InChIKey:FLAFSUWTRZQCEL-UHFFFAOYSA-N
ID: 119742
SMILES:C1(C(C)C)CC(=O)C2(C)Oc3cc(C)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.125
InChIKey:FQKKXPYZWJFDML-UHFFFAOYSA-N